Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPD1 | P10809 | 1/20 | 0.59 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 2/20 | 0.58 |
| ▸ | PKM | P14618 | 2/20 | 0.58 |
| ▸ | HTR6 | P50406 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CDC7 | O00311 | 1/20 | 0.47 |
| ▸ | EEF2K | O00418 | 1/20 | 0.47 |
| ▸ | PLK4 | O00444 | 1/20 | 0.47 |
| ▸ | AURKA | O14965 | 1/20 | 0.47 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.47 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.47 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.47 |
| ▸ | PIM1 | P11309 | 1/20 | 0.47 |
| ▸ | PHKG2 | P15735 | 1/20 | 0.47 |
| ▸ | CDK2 | P24941 | 1/20 | 0.47 |
| ▸ | AKT1 | P31749 | 1/20 | 0.47 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8313217 | 0.85 | CDC7 (0.64) | HSPD1HSPE1HTR6KMT2AALDH1A1 | |
| SCHEMBL8313917 | 0.81 | POLB (0.58) | HSPD1HSPE1POLBPKMHTR6 | |
| SCHEMBL8311699 | 0.80 | HSPD1 (0.62) | HSPD1HSPE1KMT2AALDH1A1CA2 | |
| SCHEMBL28271796 | 0.79 | HTR6 (0.83) | HSPD1HSPE1POLBPKMHTR6 | |
| SCHEMBL31702160 | 0.78 | HSPD1 (0.61) | HSPD1HSPE1POLBPKMHTR6 | |
| SCHEMBL8315915 | 0.76 | CDK2 (0.48) | KMT2AALDH1A1SMN1; SMN2CDC7EEF2K | |
| SCHEMBL3973555 | 0.75 | POLB (1.00) | POLBPKMHTR6KMT2AALDH1A1 | |
| SCHEMBL31701133 | 0.74 | HSPD1 (1.00) | HSPD1HSPE1KMT2AALDH1A1PTPN2 | |
| SCHEMBL14093757 | 0.74 | POLB (0.73) | POLBPKMHTR6KMT2ASMN1; SMN2 | |
| SCHEMBL7131571 | 0.74 | POLB (0.73) | HSPD1HSPE1POLBPKMHTR6 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0733626-B1 | N-(Benzofuranazyl)-arylsulphonamides and their analogues useful as endothelin-receptor-antagonists | MERCK PATENT GMBH (DE) | 1999-01-13 | — | — | EP | disclosed |
| US-5726194-A | Endothelin receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-03-10 | — | — | US | disclosed |
| EP-0733626-A1 | N-(Benzofuranazyl)-arylsulphonamides and their analogues useful as endothelin-receptor-antagonists | MERCK PATENT GmbH (DE) | 1996-09-25 | — | — | EP | disclosed |